0 mol 19 unq 0 iso 0 dist 6.41045 13.3276 8.4674 10.4834 8.40416 9.74255 14.6799 10.4416 13.0732 8.54034 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 6.41045 7.64353 4.51865 10.4834 8.40416 7.08342 14.6799 10.4416 12.2354 8.54034 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.0319 11.4109 6.86014 15.919 9.01567 8.67951 15.9164 8.91183 12.5088 6.19899 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.0319 11.4109 6.86014 15.919 9.01567 8.67951 17.6884 13.0212 15.4457 8.49709 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 8.0319 11.4109 6.86014 15.2997 7.29868 8.52463 15.9164 8.91183 12.5088 6.61696 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 8.0319 11.4109 6.86014 15.2997 7.29868 8.52463 12.1911 5.69214 7.95042 5.80953 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 7.23812 12.8453 9.96396 14.7042 9.24757 5.11416 13.1768 6.20232 12.2276 8.96616 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 7.23812 12.8453 9.96396 14.7042 9.24757 5.11416 12.8474 5.70116 9.73086 6.14542 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 7.23812 9.59988 6.19304 14.7042 9.24757 6.56633 13.1768 6.20232 8.68662 8.96616 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 7.23812 9.59988 6.19304 14.7042 9.24757 6.56633 12.8474 5.70116 7.4369 6.14542 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 7.23812 7.80518 8.70481 14.7042 9.24757 15.3808 13.1768 6.20232 13.8931 8.96616 numMergedOcc 0
11 mol 73 unq 5 iso 0 dist 7.23812 7.80518 8.70481 14.7042 9.24757 15.3808 12.8474 5.70116 12.8207 6.14542 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 7.689 14.9329 9.60661 12.5859 7.01812 5.80144 11.7018 4.03277 8.91882 6.59691 numMergedOcc 0
13 mol 100 unq 1 iso 0 dist 7.689 5.71475 7.17106 12.5859 7.01812 8.4128 11.7018 4.03277 10.5432 6.59691 numMergedOcc 0
14 mol 100 unq 2 iso 0 dist 7.689 10.3954 9.35224 12.5859 7.01812 10.0456 11.7018 4.03277 11.5088 6.59691 numMergedOcc 0
15 mol 100 unq 3 iso 0 dist 9.22737 12.9061 7.47343 10.6748 8.30845 12.2861 13.861 6.23008 9.76432 6.59691 numMergedOcc 0
16 mol 100 unq 4 iso 0 dist 9.22737 6.60925 6.65086 10.6748 8.30845 5.80144 13.861 6.23008 8.91882 6.59691 numMergedOcc 0
17 mol 100 unq 5 iso 0 dist 9.22737 4.95357 6.56369 10.6748 8.30845 10.0456 13.861 6.23008 11.5088 6.59691 numMergedOcc 0
18 mol 100 unq 6 iso 0 dist 9.22737 5.05858 9.30209 10.6748 8.30845 6.70236 13.861 6.23008 11.6812 6.59691 numMergedOcc 0
19 mol 109 unq 0 iso 0 dist 9.41191 12.7291 8.69985 13.7792 7.80523 7.74599 14.206 5.00433 8.52024 7.56755 numMergedOcc 0
20 mol 129 unq 0 iso 0 dist 8.59695 6.13737 5.83384 7.95267 4.97175 7.29399 13.9579 6.16616 11.8464 9.35533 numMergedOcc 0
21 mol 129 unq 1 iso 0 dist 6.42706 5.12351 5.83384 8.03693 4.97175 7.29399 11.2637 6.16616 11.8464 9.35533 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 8.97762 9.74121 6.29155 11.4871 6.16242 4.54648 11.716 13.0405 8.77023 8.83732 numMergedOcc 0
23 mol 170 unq 0 iso 0 dist 9.32245 6.45787 9.76807 4.11212 6.35982 4.34698 9.66676 4.78249 9.51256 6.47164 numMergedOcc 0
24 mol 170 unq 1 iso 0 dist 9.32245 6.45787 9.76807 9.2613 7.51126 5.75144 9.66676 4.78249 9.51256 9.65126 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 7.7544 10.8374 7.81386 7.18433 9.39829 7.20191 5.97971 5.71898 9.01624 5.99437 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 7.7544 10.8374 7.81386 7.18433 9.39829 7.20191 9.30874 5.83796 9.55105 8.4848 numMergedOcc 0
27 mol 182 unq 0 iso 0 dist 9.06702 13.1207 9.31746 7.42577 6.73956 7.68794 9.82379 4.88992 13.5224 8.62102 numMergedOcc 0
